2,3,5,6-Tetrafluorobenzoyl chloride

C₇HClF₄OCAS 107535-73-9212.53 g/mol

Open in Covalent MOL file

Acyl halide Aryl halide

Properties

Molecular formula: C₇HClF₄O
Molar mass: 212.53 g/mol
Exact mass: 211.9652 Da
logP: 2.62Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Hazards

Danger

H290 May be corrosive to metals20% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers
H318 Causes serious eye damage20% of notifiers

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P234, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P390, P405, P406, P501

Identifiers

CAS number

107535-73-9

SMILES

C1=C(C(=C(C(=C1F)F)C(=O)Cl)F)F

InChIKey

AELMDUZWKHVPIF-UHFFFAOYSA-N

InChI

InChI=1S/C7HClF4O/c8-7(13)4-5(11)2(9)1-3(10)6(4)12/h1H

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 2,3,5,6-Tetrafluorobenzoyl chloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,3,6-Trifluorobenzoyl chloride189807-20-368 % similar 3,4,5-Trifluorobenzoyl chloride177787-26-764 % similar Pentafluorobenzoyl chloride2251-50-564 % similar 2,3,5-Trifluorobenzoyl chloride240800-48-061 % similar 2,4,6-Trifluorobenzoyl chloride79538-29-759 % similar 2,6-Difluoro-3-methylbenzoyl chloride261763-39-758 % similar 2,6-Difluorobenzoyl chloride18063-02-055 % similar 2,4,5-Trifluorobenzoyl chloride88419-56-155 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,3,4,5-Tetrafluorobenzoyl chloride94695-48-4

Elsewhere

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